Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 14/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 6/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL19159432 | 0.92 | NPC1 (0.47) | ESR2POLBESR1CYP3A4CYP2C9 | |
| SCHEMBL18773546 | 0.90 | ESR2 (0.40) | ESR2POLBESR1CYP3A4CYP2C9 | |
| SCHEMBL18411594 | 0.87 | SLC18A3 (0.54) | CYP2C9NPC1RAB9ASLC18A3SIGMAR1 | |
| SCHEMBL19883146 | 0.84 | LMNA (0.40) | ESR2POLBESR1CYP3A4CYP2C9 | |
| SCHEMBL21338798 | 0.84 | NPC1 (0.59) | ESR2NOTUMNPC1RAB9ASLC18A3 | |
| SCHEMBL19393897 | 0.84 | NOTUM (0.50) | ESR2ESR1NOTUMNPC1RAB9A | |
| SCHEMBL20169911 | 0.84 | NPC1 (0.59) | ESR2NOTUMNPC1RAB9ASLC18A3 | |
| SCHEMBL19883114 | 0.84 | ESR2 (0.36) | ESR2POLBESR1CYP3A4CYP2C9 | |
| SCHEMBL20080961 | 0.84 | NOTUM (0.50) | ESR2ESR1NOTUMNPC1RAB9A | |
| SCHEMBL2884020 | 0.84 | ESR2 (0.57) | ESR2POLBESR1CYP3A4CYP2C9 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3239273-B1 | NEMATIC LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT USING THE SAME | DAINIPPON INK & CHEMICALS (JP) | 2019-11-13 | — | — | EP | disclosed |